CAS Number778-94-9
Synonyms2-Nitro-4-trifluoromethylbenzotrile; 4-Cyano-3-nitrobenzotrifluoride; 2-Nitro-4-trifluormethyl-benzonitril; EINECS 212-298-1; MFCD00014684; 4-cyano-3-nitro-1-trifluoromethylbenzene
Molecular FormulaO2NC6H3(CF3)CN
Molecular Weight216.12
Purity99%
Density1.49 g/cm3
Boiling Point156-158 °C/18 mmHg (lit.)
Melting Point44-47 °C (lit.)
Appearancesolid
EINECS212-298-1
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 778-94-9 |
| Catalog No. | 2A-9003448 |
| Chinese Name | 4-氰基-3-硝基三氟甲基苯 |
| Synonyms | 2-Nitro-4-trifluoromethylbenzotrile; 4-Cyano-3-nitrobenzotrifluoride; 2-Nitro-4-trifluormethyl-benzonitril; EINECS 212-298-1; MFCD00014684; 4-cyano-3-nitro-1-trifluoromethylbenzene |
| Molecular Formula | O2NC6H3(CF3)CN |
| Molecular Weight | 216.12 |
| Purity | 99 |
| Density | 1.49 g/cm3 |
| Boiling Point | 156-158 °C/18 mmHg (lit.) |
| Melting Point | 44-47 °C (lit.) |
| Appearance | solid |
| Storage Condition | Store in cold, dry conditions, in a ventilated are |
| Packaging | III |
| EINECS | 212-298-1 |
| PubChem ID | 24859817 |
| MDL Number | MFCD00014684 |
| SMILES | [O-][N+](=O)c1cc(ccc1C#N)C(F)(F)F |
| InChI | 1S/C8H3F3N2O2/c9-8(10,11)6-2-1-5(4-12)7(3-6)13(14)15/h1-3H |
| InChI Key | BQCWLXXZTCLGSZ-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | 6.1 |
| MSDS | msds/3448_1_778_94_9.pdf |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: No dangerous goods IMDG Code: No dangerous goods International Air Transport Dangerous Regulations: No dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special precautions for users No data available |
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